%chk=000194846.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000194846

0 1
P -3.463948 -0.533453 -0.626493
O -0.508104 1.270900 0.808814
O 2.100487 3.000812 0.835726
O 0.611314 3.922922 -0.662865
O -2.808441 0.891100 -1.096140
O -0.050140 -1.483483 2.398899
O -2.370013 -1.305666 0.344952
O -3.206026 -1.419991 -1.985391
O -4.812653 -0.404185 -0.064016
N 1.018516 -0.498516 0.476909
N 0.804129 -2.821120 0.572959
N 2.097244 -0.357835 -1.794389
N 2.499421 -2.552496 -2.800374
N 1.888186 -4.580827 -1.747479
C 1.652057 1.911551 0.025004
C 0.577729 2.515330 -0.925450
C 0.876921 0.906259 0.917442
C -0.777058 1.926000 -0.464212
C 1.269337 4.182513 0.610990
C -1.397461 0.913700 -1.433169
C 0.248406 4.308390 1.721248
C 2.198330 5.358609 0.414509
C 1.555750 -1.013986 -0.717450
C 0.547303 -1.665631 1.195091
C 1.437916 -2.445417 -0.629262
C 1.941245 -3.213801 -1.720122
C -1.461542 -1.907340 2.425689
C -2.341310 -0.874847 1.730719
C 2.542726 -1.187594 -2.780868
C -3.889265 -2.696835 -2.009334
H 2.567667 1.514156 -0.460834
H 0.789576 2.411880 -2.005739
H 1.097730 0.982798 2.010940
H -1.516217 2.719255 -0.194281
H -1.377759 1.276712 -2.481755
H -0.918991 -0.082322 -1.373348
H 0.720832 4.587208 2.670857
H -0.507846 5.066446 1.480968
H -0.283829 3.359030 1.889848
H 3.003188 5.350042 1.162577
H 2.676086 5.318805 -0.576233
H 1.669013 6.315995 0.484900
H -1.629906 -1.953732 3.517786
H -1.550434 -2.910074 1.964469
H -3.366088 -0.862320 2.154838
H -1.881254 0.141293 1.777923
H 2.988705 -0.705336 -3.668610
H 2.275340 -5.096585 -2.522176
H 1.510931 -5.090211 -0.962630
H -3.403885 -3.395294 -1.315300
H -3.736546 -3.028690 -3.047366
H -4.962871 -2.590020 -1.803872


%chk=000194846-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000194846

0 1
P -3.391279 -0.651526 -0.650334
O -0.633345 1.394166 0.802922
O 2.132138 2.968940 0.916553
O 0.806543 4.040157 -0.715182
O -2.885608 0.934745 -1.047133
O -0.083593 -1.358476 2.426031
O -2.300176 -1.335839 0.515684
O -2.801921 -1.486820 -2.031181
O -4.918139 -0.725321 -0.244105
N 0.871018 -0.494257 0.416478
N 0.556756 -2.779005 0.561832
N 1.749971 -0.385390 -1.925960
N 1.916237 -2.611077 -2.955563
N 1.304978 -4.595047 -1.823273
C 1.604363 1.900956 0.056656
C 0.599262 2.601619 -0.916970
C 0.753866 0.903961 0.878520
C -0.816668 2.114473 -0.488846
C 1.411553 4.247293 0.628250
C -1.510970 1.231736 -1.531171
C 0.339043 4.499158 1.698783
C 2.444610 5.363291 0.505601
C 1.283148 -1.032441 -0.818435
C 0.425000 -1.598401 1.175918
C 1.091168 -2.435934 -0.695067
C 1.438136 -3.230948 -1.822926
C -1.443196 -1.921043 2.675677
C -2.504026 -1.087802 1.963470
C 2.038796 -1.251706 -2.946945
C -2.797496 -2.969868 -2.049493
H 2.446313 1.422049 -0.461283
H 0.822727 2.387001 -1.972752
H 1.020854 0.922678 1.945187
H -1.464993 2.978209 -0.265794
H -1.650225 1.798372 -2.469113
H -0.956963 0.303799 -1.751411
H 0.824356 4.665379 2.676233
H -0.248724 5.396787 1.439013
H -0.337898 3.633643 1.790241
H 2.974956 5.494319 1.463855
H 3.175046 5.109550 -0.278720
H 1.947397 6.312322 0.241675
H -1.570043 -1.859688 3.768056
H -1.465131 -2.972106 2.338643
H -3.518856 -1.412633 2.264922
H -2.365277 -0.011603 2.170952
H 2.413404 -0.800091 -3.870153
H 1.587071 -5.116801 -2.650465
H 0.993579 -5.075236 -0.981849
H -2.129296 -3.359004 -1.262295
H -2.411798 -3.229977 -3.046081
H -3.822174 -3.362465 -1.923755


